[2-[4-[4-(4-ethoxyphenyl)pyrimidin-2-yl]piperazin-1-yl]-2-oxidanylidene-1-phenyl-ethyl] ethanoate

Systemtic Name: [2-[4-[4-(4-ethoxyphenyl)pyrimidin-2-yl]piperazin-1-yl]-2-oxidanylidene-1-phenyl-ethyl] ethanoate Openeye Name: [2-[4-[4-(4-ethoxyphenyl)pyrimidin-2-yl]piperazin-1-yl]-2-oxo-1-phenyl-ethyl] acetate CAS Name: acetic acid [2-[4-[4-(4-ethoxyphenyl)-2-pyrimidinyl]-1-piperazinyl]-2-oxo-1-phenylethyl] ester IUPAC Name: [2-[4-[4-(4-ethoxyphenyl)pyrimidin-2-yl]piperazin-1-yl]-2-oxo-1-phenylethyl] acetate Traditional Name: acetic acid [2-keto-1-phenyl-2-[4-(4-p-phenetylpyrimidin-2-yl)piperazino]ethyl] ester Formula: C26H28N4O4 MolecularWeight: 460.52492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC(=NC=C2)N3CCN(CC3)C(=O)C(C4=CC=CC=C4)OC(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC(=NC=C2)N3CCN(CC3)C(=O)C(C4=CC=CC=C4)OC(=O)C

InChI

InChI=1S/C26H28N4O4/c1-3-33-22-11-9-20(10-12-22)23-13-14-27-26(28-23)30-17-15-29(16-18-30)25(32)24(34-19(2)31)21-7-5-4-6-8-21/h4-14,24H,3,15-18H2,1-2H3